TY - JOUR
T1 - Including nonlocality in the exchange-correlation kernel from time-dependent current density functional theory
T2 - Application to the stopping power of electron liquids
AU - Nazarov, V. U.
AU - Pitarke, J. M.
AU - Takada, Y.
AU - Vignale, G.
AU - Chang, Y. C.
PY - 2007/11/9
Y1 - 2007/11/9
N2 - We develop a scheme for building the scalar exchange-correlation (XC) kernel of time-dependent density functional theory (TDDFT) from the tensorial kernel of time-dependent current density functional theory (TDCDFT) and the Kohn-Sham current density response function. Resorting to the local approximation to the kernel of TDCDFT results in a nonlocal approximation to the kernel of TDDFT, which is free of the contradictions that plague the standard local density approximation (LDA) to TDDFT. As an application of this general scheme, we calculate the dynamical XC contribution to the stopping power of electron liquids for slow ions to find that our results are in considerably better agreement with experiment than those obtained using TDDFT in the conventional LDA.
AB - We develop a scheme for building the scalar exchange-correlation (XC) kernel of time-dependent density functional theory (TDDFT) from the tensorial kernel of time-dependent current density functional theory (TDCDFT) and the Kohn-Sham current density response function. Resorting to the local approximation to the kernel of TDCDFT results in a nonlocal approximation to the kernel of TDDFT, which is free of the contradictions that plague the standard local density approximation (LDA) to TDDFT. As an application of this general scheme, we calculate the dynamical XC contribution to the stopping power of electron liquids for slow ions to find that our results are in considerably better agreement with experiment than those obtained using TDDFT in the conventional LDA.
UR - http://www.scopus.com/inward/record.url?scp=36048958491&partnerID=8YFLogxK
U2 - 10.1103/PhysRevB.76.205103
DO - 10.1103/PhysRevB.76.205103
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AN - SCOPUS:36048958491
SN - 1098-0121
VL - 76
JO - Physical Review B - Condensed Matter and Materials Physics
JF - Physical Review B - Condensed Matter and Materials Physics
IS - 20
M1 - 205103
ER -